SCHEMBL8387402

SCHEMBL8387402

CC1(C)Cc2c(Br)cc(C(F)(F)F)cc2O1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 1/20 0.33
▸ PTGES O14684 2/20 0.31
▸ ALOX5 P09917 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8390871 0.80 ALDH1A1 (0.33) —
SCHEMBL8390674 0.78 PTGES (0.32) PTGESALOX5
SCHEMBL8388374 0.75 ALDH1A1 (0.35) PTGES
SCHEMBL17027205 0.73 GABRB3 (0.33) —
SCHEMBL18581061 0.72 GABRB3 (0.33) —
SCHEMBL17535782 0.71 ALDH1A1 (0.33) —
SCHEMBL17026989 0.69 GABRB3 (0.33) —
SCHEMBL24212283 0.69 TP53 (0.38) NFE2L2
SCHEMBL31545496 0.69 TP53 (0.38) NFE2L2
SCHEMBL17535566 0.69 — —

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5874579-A Insecticidal substituted-2.4-diaminoquinazolines related applications FMC CORPORATION (US) 1999-02-23 — — US disclosed
US-5616718-A USEFUL FOR MAKING 2,4-DIAMINOQUINAZOLINES; INSECTICIDES FMC CORPORATION (US) 1997-04-01 — — US disclosed
US-5534518-A Insecticidal substituted-2,4-diaminoquinazolines FMC CORPORATION (US) 1996-07-09 — — US disclosed
Send feedback